![1-[1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-yl]ethanone](/api/spectrum/IGPMzfJZW23/structure.png?h=300&w=458 "1-[1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-yl]ethanone")
| SpectraBase Compound ID | 87wTJfDchU4 |
|---|---|
| InChI | InChI=1S/C12H10F3N3O2/c1-7(19)10-11(12(13,14)15)18(17-16-10)8-3-5-9(20-2)6-4-8/h3-6H,1-2H3 |
| InChIKey | JAPCHPAJRWWOFQ-UHFFFAOYSA-N |
| Mol Weight | 285.23 g/mol |
| Molecular Formula | C12H10F3N3O2 |
| Exact Mass | 285.072511 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IGPMzfJZW23 |
|---|---|
| Name | 1-[1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-1,2,3-triazole-4-yl]ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.072511061 u |
| Formula | C12H10F3N3O2 |
| InChI | InChI=1S/C12H10F3N3O2/c1-7(19)10-11(12(13,14)15)18(17-16-10)8-3-5-9(20-2)6-4-8/h3-6H,1-2H3 |
| InChIKey | JAPCHPAJRWWOFQ-UHFFFAOYSA-N |
| Molecular Weight | 285.226 g/mol |
| SMILES | C1(=C(N=NN1C=1C=CC(=CC1)OC)C(=O)C)C(F)(F)F |